SCHEMBL23633731

SCHEMBL23633731

C=C(C)C(=O)OC1CC2CC1C(C)C2C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
GPX4 P36969 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23633754 0.84 GPX4 (0.31) GPX4
SCHEMBL13879030 0.82 ALDH1A1 (0.35) ALDH1A1GPX4NPC1RAB9A
SCHEMBL111434 0.82 CHRM2 (0.39) ALDH1A1MAPTTDP1
SCHEMBL13790985 0.82 CHRM2 (0.39) ALDH1A1MAPTTDP1
SCHEMBL19077668 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL12200682 0.80 ALDH1A1 (0.49) ALDH1A1KDM4ENPC1MAPTRAB9A
SCHEMBL10064106 0.79 ALDH1A1 (0.33) ALDH1A1KDM4ENPC1POLBMAPT
SCHEMBL76534 0.79 CHRM2 (0.35) ALDH1A1GPX4
SCHEMBL23633756 0.79 GPX4 (0.32) ALDH1A1GPX4
SCHEMBL25618991 0.78 GPX4 (0.35) ALDH1A1GPX4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11059923-B2 Preparation method for high-solid acrylic resin WUXI ACRYL TECHNOLOGY CO., LTD (CN) 2021-07-13 US disclosed